SCHEMBL7832891

SCHEMBL7832891

CC(O)CCc1cc(Oc2ccc(Cl)cc2Cl)n2nccc2n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.35
FFAR1 O14842 1/20 0.35
LOXL2 Q9Y4K0 1/20 0.34
SLC6A2 P23975 3/20 0.34
HPGD P15428 2/20 0.34
SLC6A3 Q01959 2/20 0.34
LMNA P02545 2/20 0.34
PDE10A Q9Y233 1/20 0.34
NR1I2 O75469 1/20 0.34
TTR P02766 1/20 0.34
PGR P06401 1/20 0.34
HSP90AA1 P07900 1/20 0.34
ADORA3 P0DMS8 1/20 0.34
MAPT P10636 1/20 0.34
HSPA5 P11021 1/20 0.34
CBR1 P16152 1/20 0.34
TBXA2R P21731 1/20 0.34
AGTR1 P30556 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7835386 0.88 LOXL2 (0.39) FFAR1LOXL2LMNAPDE10AALDH1A1
SCHEMBL7833790 0.86 MAPT (0.38) FFAR1LOXL2HPGDLMNAMAPT
SCHEMBL7833197 0.86 LOXL2 (0.40) POLBLOXL2PDE10AMAPTNPC1
SCHEMBL7829453 0.83 LOXL2 (0.46) FFAR1LOXL2PDE10AL3MBTL1
SCHEMBL7831183 0.82 S1PR4 (0.35) LOXL2SLC6A2HPGDSLC6A3LMNA
SCHEMBL7830320 0.81 S1PR4 (0.36) LOXL2SLC6A2HPGDSLC6A3LMNA
SCHEMBL7831474 0.81 PDE10A (0.35) LOXL2SLC6A2HPGDSLC6A3LMNA
SCHEMBL7832013 0.80 KDM5A (0.39) LMNAPDE10AMAPTHTTL3MBTL1
SCHEMBL7821057 0.79 LOXL2 (0.37) LOXL2PDE10A
SCHEMBL7831627 0.79 LOXL2 (0.50) LOXL2SLC6A3LMNAPDE10A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0820997-B1 PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES OTSUKA PHARMA CO LTD (JP) 2001-07-25 EP disclosed
US-5985882-A ANALGESICS OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1999-11-16 US disclosed
EP-0820997-A1 PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVES OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1998-01-28 EP disclosed